Table 4. Average Binding Energies (Eb, eV) of AgGenλ and Gen + 1λ (λ = −1, 0, and +1; n = 1–13) Clustersa.
| Eb | ||||||
|---|---|---|---|---|---|---|
| n | AgGen– | AgGen | AgGen+ | Gen + 1– | Gen + 1 | Gen + 1+ |
| 1 | 1.00 (1.00) | 0.87 (0.87) | 1.26 (1.25) | 1.79 (1.77) | 1.44 (1.42) | 1.57 (1.56) |
| 2 | 2.00 (1.98) | 1.72 (1.70) | 1.97 (1.95) | 2.44 (2.41) | 2.14 (2.12) | 2.11 (2.09) |
| 3 | 2.42 (2.40) | 2.09 (2.07) | 2.33 (2.31) | 2.79 (2.76) | 2.63 (2.61) | 2.71 (2.68) |
| 4 | 2.57 (2.55) | 2.35 (2.33) | 2.65 (2.62) | 3.02 (2.99) | 2.82 (2.80) | 2.83 (2.80) |
| 5 | 2.88 (2.86) | 2.66 (2.63) | 2.86 (2.84) | 3.11 (3.08) | 3.00 (2.98) | 3.08 (3.05) |
| 6 | 2.91 (2.88) | 2.75 (2.72) | 2.97 (2.94) | 3.20 (3.17) | 3.11 (3.09) | 3.15 (3.13) |
| 7 | 2.99 (2.96) | 2.84 (2.81) | 3.10 (3.08) | 3.14 (3.10) | 3.01 (2.99) | 3.17 (3.14) |
| 8 | 3.03 (3.00) | 2.86 (2.84) | 3.05 (3.02) | 3.24 (3.21) | 3.11 (3.08) | 3.11 (3.17) |
| 9 | 3.11 (3.09) | 2.93 (2.90) | 3.11 (3.09) | 3.31 (3.28) | 3.23 (3.20) | 3.27 (3.25) |
| 10 | 3.18 (3.15) | 3.02 (2.99) | 3.22 (3.19) | 3.25 (3.22) | 3.15 (3.12) | 3.29 (3.26) |
| 11 | 3.15 (3.12) | 3.00 (2.97) | 3.16 (3.13) | 3.23 (3.20) | 3.16 (3.13) | 3.24 (3.21) |
| 12 | 3.17 (3.16) | 3.02 (3.00) | 3.18 (3.15) | 3.27 (3.24) | 3.16 (3.13) | 3.24 (3.22) |
| 13 | 3.22 (3.19) | 3.05 (3.02) | 3.18 (3.16) | 3.28 (3.26) | 3.22 (3.19) | 3.29 (3.26) |
a
The values in parentheses are calculated at the mPW2PLYP/aug-cc-pVTZ-pp level.